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cis-ACCP

CAT: 0607-C4501-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-C4501-5Size:5 mg
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Description
type IV collagen-specific MMP-2 and MMP-9 inhibitor
CAS Number
777075-44-2
Product Name Alternative
P-[[[(1R,2S)-2-aminocyclohexyl]amino]carbonyl]-phosphonic acid
Field of Research
Proteases MMP
Purity
≥ 95.00%
Form
A crystalline solid
Solubility
≤0.15mg/ml in ethanol;0.3mg/ml in PBS, pH 7.2,
Smiles
N[C@H]1CCCC[C@H]1NC(P(O)(O)=O)=O
Molecular Formula
C7H15N2O4P
Molecular Weight
222.2
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Cis-2-aminocyclohexylcarbamoylphosphonic acid
CAS Number777075-44-2
PubChem CID44457233
IUPAC Name[(1R,2S)-2-aminocyclohexyl]carbamoylphosphonic acid
Molecular FormulaC7H15N2O4P
Molecular Weight222.18
XLogP-3.9
Topological Polar Surface Area113
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity264
SMILES
C1CC[C@H]([C@H](C1)N)NC(=O)P(=O)(O)O
InChI
InChI=1S/C7H15N2O4P/c8-5-3-1-2-4-6(5)9-7(10)14(11,12)13/h5-6H,1-4,8H2,(H,9,10)(H2,11,12,13)/t5-,6+/m0/s1
InChIKey
XHCXISPZIHYKQD-NTSWFWBYSA-N
Chemical Structure
2D Structure
2D structure of Cis-2-aminocyclohexylcarbamoylphosphonic acid
CAS: 777075-44-2
CID: 44457233
Formula: C7H15N2O4P
MW: 222.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight222.18
XLogP3-3.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass222.07694396
Monoisotopic Mass222.07694396
Topological Polar Surface Area113 Ų
Heavy Atom Count14
Formal Charge0
Complexity264
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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